N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride

C16H18ClN3O2 — CID 119515874

IUPACN-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride
SMILESCl.Nc1ccc(NC(=O)c2ccccc2OCC2CC2)cn1
InChIInChI=1S/C16H17N3O2.ClH/c17-15-8-7-12(9-18-15)19-16(20)13-3-1-2-4-14(13)21-10-11-5-6-11;/h1-4,7-9,11H,5-6,10H2,(H2,17,18)(H,19,20);1H
InChIKeyBGQYWDGYUASLKZ-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.13
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride

N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride (PubChem CID 119515874) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride
PubChem CID119515874
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC NameN-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride
SMILESCl.Nc1ccc(NC(=O)c2ccccc2OCC2CC2)cn1
InChIInChI=1S/C16H17N3O2.ClH/c17-15-8-7-12(9-18-15)19-16(20)13-3-1-2-4-14(13)21-10-11-5-6-11;/h1-4,7-9,11H,5-6,10H2,(H2,17,18)(H,19,20);1H
InChIKeyBGQYWDGYUASLKZ-UHFFFAOYSA-N
XLogP3.13
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylmethoxy)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 155944356
N-(6-amino-3-pyridinyl)-2-cyclopropylacetamide
CID 62901685
(2S)-N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)propanamide
CID 99776072
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
N-(6-amino-3-pyridinyl)-3-cyclopropylpropanamide
CID 119515078
4-[[2-(cyclopropylmethoxy)benzoyl]amino]butanoic acid
CID 119170749
2-bromo-1-[2-(cyclopropylmethoxy)phenyl]ethanone
CID 95927871
3-N-(6-amino-3-pyridinyl)-1-N-(cyclohexylmethyl)-4-methylbenzene-1,3-dicarboxamide
CID 44560639
ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate
CID 110178230
N-(6-amino-3-pyridinyl)quinoline-5-carboxamide
CID 62901696
2-(cyclopropylmethoxy)-N-[(4-hydroxypyrrolidin-3-yl)methyl]benzamide
CID 120944904
4-[[[2-(cyclopropylmethoxy)benzoyl]amino]methyl]benzoic acid
CID 119165490

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride (CID 119515874) is N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride is Cl.Nc1ccc(NC(=O)c2ccccc2OCC2CC2)cn1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride?
The InChIKey is BGQYWDGYUASLKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2.ClH/c17-15-8-7-12(9-18-15)19-16(20)13-3-1-2-4-14(13)21-10-11-5-6-11;/h1-4,7-9,11H,5-6,10H2,(H2,17,18)(H,19,20);1H.
What are the key properties of N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride?
N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride has a molecular weight of 319.79 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)benzamide;hydrochloride is sourced from PubChem (CID 119515874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).